Abstract
The metabolism of cancer cells is altered to support rapid proliferation. Pharmacological activators of a tumor cell specific pyruvate kinase isozyme (PKM2) may be an approach for altering the classic Warburg effect characteristic of aberrant metabolism in cancer cells yielding a novel antiproliferation strategy. In this manuscript, we detail the discovery of a series of substituted N,N'-diarylsulfonamides as activators of PKM2. The synthesis of numerous analogues and the evaluation of structure-activity relationships are presented as well as assessments of mechanism and selectivity. Several agents are found that have good potencies and appropriate solubility for use as chemical probes of PKM2 including 55 (AC(50) = 43 nM, maximum response = 84%; solubility = 7.3 microg/mL), 56 (AC(50) = 99 nM, maximum response = 84%; solubility = 5.7 microg/mL), and 58 (AC(50) = 38 nM, maximum response = 82%; solubility = 51.2 microg/mL). The small molecules described here represent first-in-class activators of PKM2.
MeSH Terms
Binding Sites
Enzyme Activation/drug effects
Enzyme Inhibitors/pharmacology
Humans
L-Lactate Dehydrogenase/metabolism
Luciferases/metabolism
Molecular Structure
Pyruvate Kinase/metabolism
Small Molecule Libraries
Structure-Activity Relationship
Sulfonamides/chemical synthesis,chemistry,pharmacology
Chemicals
Enzyme Inhibitors
Small Molecule Libraries
Sulfonamides
L-Lactate Dehydrogenase
Luciferases
Pyruvate Kinase
Authors & Affiliations
14 authors, click to expand affiliations / ORCID
Boxer Matthew B
NIH Chemical Genomics Center, National Human Genome Research Institute, National Institutes of Health, 9800 Medical Center Drive, MSC 3370 Bethesda, Maryland 20850, USA.
Jiang Jian-kang
Vander Heiden Matthew G
Shen Min
Skoumbourdis Amanda P
Southall Noel
Veith Henrike
Leister William
Austin Christopher P
Park Hee Won
Inglese James
Cantley Lewis C
Auld Douglas S
Thomas Craig J
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